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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesquiterpenoid > gibberellenic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > gibberellenic acid

Preferred term

gibberellenic acid  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C19H22O6

inchi

  • InChI=1S/C19H22O6/c1-9-7-18-8-19(9,25)6-5-11(18)10-3-4-12(20)17(2,16(23)24)13(10)14(18)15(21)22/h3-4,12-14,20,25H,1,5-8H2,2H3,(H,21,22)(H,23,24)/t12-,13?,14+,17+,18-,19-/m0/s1

inchikey

  • JAHZEMKSAYRHSW-ZUVLIYFWSA-N

mass

  • 346.379

monoisotopicmass

  • 346.14164

smiles

  • O=C(O)[C@@]1([C@@H](O)C=CC=2C1[C@H](C(=O)O)[C@@]34CC(=C)[C@](C3)(O)CCC24)C

subset

  • 2_STAR

synonym EXACT

  • (1R,2S,4S,5S,12S)-5,12-dihydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadeca-6,8-diene-2,4-dicarboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204246

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